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4-Methyl-2-(p-tolylsulfonylmethyl)hept-1-en-4-ol

View entire compound with spectra: 1 MS (GC)

4-Methyl-2-(p-tolylsulfonylmethyl)hept-1-en-4-ol
SpectraBase Compound ID IRxmhlCKLWA
InChI InChI=1S/C16H24O3S/c1-5-10-16(4,17)11-14(3)12-20(18,19)15-8-6-13(2)7-9-15/h6-9,17H,3,5,10-12H2,1-2,4H3
InChIKey ZLNGMGYYWKWDKG-UHFFFAOYSA-N
Mol Weight 296.42 g/mol
Molecular Formula C16H24O3S
Exact Mass 296.144616 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4kpGthUZbU
Name 4-Methyl-2-(p-tolylsulfonylmethyl)hept-1-en-4-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H24O3S
InChI InChI=1S/C16H24O3S/c1-5-10-16(4,17)11-14(3)12-20(18,19)15-8-6-13(2)7-9-15/h6-9,17H,3,5,10-12H2,1-2,4H3
InChIKey ZLNGMGYYWKWDKG-UHFFFAOYSA-N
Molecular Weight 296.425 g/mol
SMILES OC(CC(CS(c1ccc(cc1)C)(=O)=O)=C)(CCC)C
SPLASH splash10-053h-5910000000-615aa1d06244f86bf9d8
Source of Spectrum F-48-5189-12
Synonyms 4-Methyl-2-(tosylmethyl)hept-1-en-4-ol 4-Methyl-2-[(4-methylphenyl)sulfonylmethyl]hept-1-en-4-ol
Wiley ID 1299004